1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide

C13H19N3O — CID 24708548

IUPAC1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)NCc2ccccn2)CCCCC1
InChIInChI=1S/C13H19N3O/c14-13(7-3-1-4-8-13)12(17)16-10-11-6-2-5-9-15-11/h2,5-6,9H,1,3-4,7-8,10,14H2,(H,16,17)
InChIKeyIXBUWLGNASBZJB-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.36
Rot. Bonds3

About 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide

1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide (PubChem CID 24708548) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
PubChem CID24708548
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)NCc2ccccn2)CCCCC1
InChIInChI=1S/C13H19N3O/c14-13(7-3-1-4-8-13)12(17)16-10-11-6-2-5-9-15-11/h2,5-6,9H,1,3-4,7-8,10,14H2,(H,16,17)
InChIKeyIXBUWLGNASBZJB-UHFFFAOYSA-N
XLogP1.36
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 24704991
1-carbamothioyl-N-(pyridin-2-ylmethyl)cyclobutane-1-carboxamide
CID 80592731
1-phenyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 30944923
1-[(pyridin-2-ylmethylcarbamoylamino)methyl]cyclohexane-1-carboxylic acid
CID 115436694
1-(pyridin-2-ylmethylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 16783827
1-cyano-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 80599426
1-(4-aminophenyl)-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 115913218
1-amino-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]cyclopentane-1-carboxamide
CID 119873315
1-amino-N-[(3-methyl-2-pyridinyl)methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119869384
2-[1-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]cyclohexyl]acetic acid
CID 2738302
3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 55165709
4-amino-N-(2-pyridin-2-ylethyl)oxane-4-carboxamide
CID 113280565

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide (CID 24708548) is 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide is NC1(C(=O)NCc2ccccn2)CCCCC1.
What is the InChIKey of 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
The InChIKey is IXBUWLGNASBZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c14-13(7-3-1-4-8-13)12(17)16-10-11-6-2-5-9-15-11/h2,5-6,9H,1,3-4,7-8,10,14H2,(H,16,17).
What are the key properties of 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 24708548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).